Potassium Ion

Potassium Ion

SCHEMBL28700682

O=C([O-])C(F)(F)Br.O=C([O-])C(F)(F)Br.[K+].[Na+]

nearest known ligand 0.44

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Known targets — ChEMBL curated mechanism

AGTR1DHFRGABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTNR3C2PBP2XPTGS1PTGS2VKORC1blablaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAftsImrcAmrcBmrdApbp1apbp1bpbp2apbp2bpbp3polthyA

The experimentally established mechanism targets of Potassium Ion. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA4 P22748 5/20 0.44
FAHD1 Q6P587 1/20 0.44
MEN1 O00255 1/20 0.37
LDHA P00338 1/20 0.37
BLM P54132 1/20 0.37
KMT2A Q03164 1/20 0.37
CASP1 P29466 1/20 0.35
CA1 P00915 3/20 0.33
CA2 P00918 2/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Potassium Ion SCHEMBL4855093 0.97
SCHEMBL2167668 0.97
SCHEMBL4850698 0.90 CASP1 (0.30) CASP1
SCHEMBL31560796 0.90 CASP1 (0.30) CASP1
SCHEMBL4851288 0.90 CASP1 (0.30) CASP1
SCHEMBL31693522 0.83
Tribromoacetic Acid SCHEMBL2079154 0.81 CA4 (0.39) CA4FAHD1MEN1LDHABLM
SCHEMBL28610481 0.80 CA4 (0.35) CA4FAHD1MEN1LDHABLM
SCHEMBL4856888 0.75 CASP1 (0.32) CA4FAHD1CASP1CA1
Potassium Ion SCHEMBL4856941 0.75 CA4 (0.32) CA4FAHD1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113999108-A Preparation method of difluorobromoacetate 南通宝凯药业有限公司 2022-02-01 CN disclosed